CHEBI:203385 - Ophiobolin A lactone

ChEBI IDCHEBI:203385
ChEBI NameOphiobolin A lactone
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SubmitterMetaboLights
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FormulaC25H36O4
Net Charge0
Average Mass400.559
Monoisotopic Mass400.26136
SMILESCC(C)=C[C@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@H]4[C@H]5/C(=C\C[C@H]32)C(=O)O[C@H]5C[C@@]4(C)O)O1
InChIInChI=1S/C25H36O4/c1-14(2)10-16-11-15(3)25(29-16)9-8-23(4)12-18-21-17(6-7-20(23)25)22(26)28-19(21)13-24(18,5)27/h6,10,15-16,18-21,27H,7-9,11-13H2,1-5H3/b17-6+/t15-,16-,18-,19-,20+,21+,23+,24+,25-/m0/s1
InChIKeyJRMCJWMKLHLRLM-XZKUGGLCSA-N
Species of MetaboliteComponentSourceComments
Pseudomonas aeruginosa (ncbitaxon:287) - DOI (10.1021/np50115a009)
ChEBI Ontology
Outgoing Relation(s)
Ophiobolin A lactone (CHEBI:203385) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(1S,3R,3'S,5'R,6S,7R,9E,13S,15R,16S)-15-hydroxy-3,3',15-trimethyl-5'-(2-methylprop-1-enyl)spiro[12-oxatetracyclo[8.5.1.03,7.013,16]hexadec-9-ene-6,2'-oxolane]-11-one
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